Geometry & MOs

Info

ID:	145681
PubChem CID:	53570271
Reduced:	OSN5C17H23 (1)
Stoich.:	ABC5D17E23 (1)
Weight, g/mol:	338.141262
ΔH_f, kcal/mol:	46.72
Dipole, Da:	5.01
IP(EA), eV:	-9.09(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[5-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanylmethyl]-1,2,4-oxadiazol-3-yl]acetamide

Drug info:

PubChemData

Smile

CCC1=NN=C2N1CCN(C2)CC(=O)N(CC3=CSC=C3)C4CC4

DOS

IR

Vibrations